3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide

C13H26N2O3 — CID 144871200

IUPAC3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide
SMILESCOCCNC(=O)C(C)C(OC)C1CCCN1C
InChIInChI=1S/C13H26N2O3/c1-10(13(16)14-7-9-17-3)12(18-4)11-6-5-8-15(11)2/h10-12H,5-9H2,1-4H3,(H,14,16)
InChIKeyMXYJAFYKGZIZIH-UHFFFAOYSA-N
MW258.36 g/mol
LogP0.49
Rot. Bonds7

About 3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide

3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide (PubChem CID 144871200) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is 3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide.

Molecular Properties

Compound Name3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide
PubChem CID144871200
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC Name3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide
SMILESCOCCNC(=O)C(C)C(OC)C1CCCN1C
InChIInChI=1S/C13H26N2O3/c1-10(13(16)14-7-9-17-3)12(18-4)11-6-5-8-15(11)2/h10-12H,5-9H2,1-4H3,(H,14,16)
InChIKeyMXYJAFYKGZIZIH-UHFFFAOYSA-N
XLogP0.49
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[1-cyclopropyl-2-[[4-(methylamino)phenyl]methylamino]-2-oxoethyl]-3-methoxy-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide
CID 146429020
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide
CID 63760320
(1R,2R,5S,6R)-6-hydroxy-1-methoxy-2,5-dimethyl-1-[(2S)-1-methylpyrrolidin-2-yl]-6-phenylhexan-3-one
CID 58340626
2-[(1-ethylpyrrolidin-2-yl)methylamino]-N-(2-methoxyethyl)propanamide
CID 43087685
ethyl 3-methoxy-3-[1-(3-methoxypropanoyl)pyrrolidin-2-yl]-2-methylpropanoate
CID 169183620
2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide
CID 115302045
tert-butyl (2S)-2-[(1R,2R)-3-[2-(4-hydroxyphenyl)ethylamino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidine-1-carboxylate
CID 53356506
(2S)-N-(2-methoxyethyl)-2-[(1S)-2,2,2-trifluoro-1-hydroxyethyl]pyrrolidine-1-carboxamide
CID 95631539
4-amino-N-(2-methoxyethyl)piperidine-1-carboxamide
CID 122417506
2-(2-methoxyethylamino)-1-(2-propan-2-ylpyrrolidin-1-yl)ethanone
CID 79290556
tert-butyl (2S)-2-[(1R,2R)-3-[2-(4-acetylphenyl)ethylamino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidine-1-carboxylate
CID 71171328
2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-(2-methoxyethyl)propanamide
CID 102731613

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide?
The IUPAC name of 3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide (CID 144871200) is 3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide.
What is the SMILES notation for 3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide?
The canonical SMILES for 3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide is COCCNC(=O)C(C)C(OC)C1CCCN1C.
What is the InChIKey of 3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide?
The InChIKey is MXYJAFYKGZIZIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-10(13(16)14-7-9-17-3)12(18-4)11-6-5-8-15(11)2/h10-12H,5-9H2,1-4H3,(H,14,16).
What are the key properties of 3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide?
3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide has a molecular weight of 258.36 g/mol, XLogP of 0.49, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(2-methoxyethyl)-2-methyl-3-(1-methylpyrrolidin-2-yl)propanamide is sourced from PubChem (CID 144871200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).